4-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one

Systemtic Name: 4-[1-[3-(azepan-1-yl)-3-oxidanylidene-propyl]benzimidazol-2-yl]-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one Openeye Name: 4-[1-[3-(azepan-1-yl)-3-oxo-propyl]benzimidazol-2-yl]-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one CAS Name: 4-[1-[3-(1-azepanyl)-3-oxopropyl]-2-benzimidazolyl]-1-[(4-methoxyphenyl)methyl]-2-pyrrolidinone IUPAC Name: 4-[1-[3-(azepan-1-yl)-3-oxopropyl]benzimidazol-2-yl]-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one Traditional Name: 4-[1-[3-(azepan-1-yl)-3-keto-propyl]benzimidazol-2-yl]-1-p-anisyl-2-pyrrolidone Formula: C28H34N4O3 MolecularWeight: 474.59456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CC(CC2=O)C3=NC4=CC=CC=C4N3CCC(=O)N5CCCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)CN2CC(CC2=O)C3=NC4=CC=CC=C4N3CCC(=O)N5CCCCCC5

InChI

InChI=1S/C28H34N4O3/c1-35-23-12-10-21(11-13-23)19-31-20-22(18-27(31)34)28-29-24-8-4-5-9-25(24)32(28)17-14-26(33)30-15-6-2-3-7-16-30/h4-5,8-13,22H,2-3,6-7,14-20H2,1H3